methyl 2-[4-[(2-fluorophenyl)methyl-(4-nitrophenyl)sulfonyl-amino]phenyl]ethanoate

Systemtic Name: methyl 2-[4-[(2-fluorophenyl)methyl-(4-nitrophenyl)sulfonyl-amino]phenyl]ethanoate Openeye Name: methyl 2-[4-[(2-fluorophenyl)methyl-(4-nitrophenyl)sulfonyl-amino]phenyl]acetate CAS Name: 2-[4-[(2-fluorophenyl)methyl-(4-nitrophenyl)sulfonylamino]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(2-fluorophenyl)methyl-(4-nitrophenyl)sulfonylamino]phenyl]acetate Traditional Name: 2-[4-[(2-fluorobenzyl)-nosyl-amino]phenyl]acetic acid methyl ester Formula: C22H19FN2O6S MolecularWeight: 458.459463

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=C(C=C1)N(CC2=CC=CC=C2F)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CC1=CC=C(C=C1)N(CC2=CC=CC=C2F)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H19FN2O6S/c1-31-22(26)14-16-6-8-18(9-7-16)24(15-17-4-2-3-5-21(17)23)32(29,30)20-12-10-19(11-13-20)25(27)28/h2-13H,14-15H2,1H3